Remove charge groups from domdec and localtop
[alexxy/gromacs.git] / src / gromacs / topology / topology.h
2019-04-18 Berk HessRemove charge groups from domdec and localtop
2019-04-02 Paul BauerRefactor gmx_group_t to SimulationAtomGroups
2019-03-02 Mark AbrahamMerge branch release-2019
2019-02-20 Paul BauerMerge branch 'release-2019' into master
2019-01-30 Mark AbrahamMerge remote branch release-2018 into release-2019
2019-01-23 Roland SchulzMerge release-2019 into master
2019-01-23 Roland SchulzMerge release-2018 into release-2019
2019-01-10 Paul BauerAdd mtop comparison function
2019-01-04 Paul BauerChange gmx_localtop_t to C++
2019-01-02 Mark AbrahamMerge branch release-2019
2018-12-31 Paul BauerMerge branch release-2018 into release-2019
2018-12-18 Szilárd PállMerge release-2019 branch into master
2018-12-17 Paul BauerMerge branch release-2018 into release-2019
2018-12-10 Paul BauerUse more const references in topology code
2018-11-21 Paul BauerMerge branch release-2018 into release-2019
2018-10-26 Mark AbrahamMerge branch release-2018 into release-2019
2018-10-16 Magnus LundborgMove gmx_ffparams_t to forcefieldparameters
2018-10-13 Viacheslav BolnykhUpdated name of intemolecular exclusions function
2018-10-12 Viacheslav BolnykhImplemented QM/MM workflow inside core GROMACS
2018-10-09 Viacheslav BolnykhImplemented changes to preprocessor to work with MiMiC...
2018-09-20 Paul BauerAlways use mtop constructor
2018-09-17 Paul BauerProperly initialize idef in topologies
2018-09-14 Berk HessChange gmx_moltype_t.ilist to InteractionLists
2018-09-13 Berk HessAdd C++ version of t_ilist
2018-09-13 Roland SchulzRemove useless comments
2018-09-09 Mark AbrahamChange TopologyInformation implementation
2018-09-09 Paul BauerRemove macro for group type in topology
2018-09-07 Magnus LundborgCheck q perturbation when PME on GPU is tested
2018-08-29 Mark AbrahamMerge branch release-2018
2018-08-24 Mark AbrahamMerge branch release-2018
2018-08-11 Roland SchulzEnable clang-tidy for headers
2018-07-04 Roland SchulzMerge release-2018 into master
2018-05-03 Mark AbrahamMerge branch release-2018
2018-04-16 Berk HessMove natoms_mol out of gmx_molblock_t
2018-04-13 Mark AbrahamMerge branch release-2018
2018-04-09 Berk HessConvert gmx_molblock_t to C++
2018-04-03 Berk HessConvert gmx_mtop_t to C++
2018-04-03 Mark AbrahamMerge "Merge branch release-2018"
2018-03-28 Berk HessRemove mols from gmx_mtop_t
2018-03-20 Mark AbrahamMerge branch release-2016 into release-2018
2018-02-16 Mark AbrahamMerge branch release-2016 into release-2018
2018-02-14 Mark AbrahamMerge branch release-2016 into release-2018
2018-02-08 Mark AbrahamMerge branch release-2016 into release-2018
2018-01-09 Mark AbrahamMerge branch release-2016 into release-2018
2017-12-22 Mark AbrahamMerge branch release-2016 into release-2018
2017-12-21 Mark AbrahamMerge branch release-5-1 into release-2016
2017-12-20 Mark AbrahamMerge branch release-2016 into release-2018
2017-12-12 Mark AbrahamMerge branch release-2016 into release-2018
2017-12-04 Mark AbrahamMerge branch release-2016 into release-2018
2017-11-02 Mark AbrahamMerge branch release-2016
2017-10-20 Mark AbrahamMerge branch release-2016
2017-10-16 Mark AbrahamMerge branch release-2016
2017-09-17 Mark AbrahamMerge branch release-2016
2017-09-12 Mark AbrahamMerge branch release-2016
2017-09-12 Szilárd PállMerge branch 'release-2016'
2017-09-03 Mark AbrahamMerge branch release-5-1 into release-2016
2017-08-22 Mark AbrahamMerge branch release-2016
2017-08-15 Mark AbrahamMerge branch release-5-1 into release-2016
2017-06-28 Mark AbrahamMerge branch release-2016
2017-06-27 Roland SchulzMerge branch release-2016
2017-05-09 Mark AbrahamMerge branch release-2016
2017-03-31 Mark AbrahamMerge branch release-2016
2017-03-14 Mark AbrahamMerge branch release-2016
2017-02-15 Mark AbrahamMerge branch release-5-1 into release-2016
2017-02-07 Mark AbrahamMerge branch release-2016
2017-02-05 Mark AbrahamMerge branch release-5-1 into release-2016
2017-01-31 Mark AbrahamMerge branch release-5-1 into release-2016
2017-01-14 Mark AbrahamMerge branch release-2016
2017-01-03 Mark AbrahamMerge branch release-5-1 into release-2016
2016-12-20 Mark AbrahamMerge branch release-2016
2016-12-12 Teemu MurtolaMerge branch release-2016
2016-12-07 Mark AbrahamMerge branch release-2016
2016-10-31 Mark AbrahamMerge branch release-2016
2016-10-31 Mark AbrahamMerge branch release-2016
2016-10-29 Berk HessAdd gmx dump option for printing parameters
2016-10-15 Teemu MurtolaFix most memory leaks recently introduced
2016-10-14 Teemu MurtolaUse gmx_mtop_t in selections, part 3
2016-10-13 Teemu MurtolaUse gmx_mtop_t in selections, part 2
2016-10-11 Teemu MurtolaSupport concurrent t_topology and gmx_mtop_t use
2016-10-11 Berk HessSpeed up mtop_util atom lookup
2016-10-09 Mark AbrahamMerge branch release-2016
2016-10-03 Mark AbrahamMerge branch release-5-1 into release-2016
2016-09-16 Berk HessMerge branch release-2016
2016-09-08 Mark AbrahamMerge branch release-5-1 into release-2016
2016-09-04 Berk HessMerge branch release-2016
2016-09-02 Berk HessMerge branch release-5-1 into release-2016
2016-08-24 Berk HessMerge branch release-5-1 into release-2016
2016-08-15 Mark AbrahamMerge branch release-2016
2016-07-29 Mark AbrahamMerge branch release-5-1 into release-2016
2016-07-23 Roland SchulzMerge release-2016 into master
2016-07-12 Mark AbrahamMerge branch release-2016
2016-07-08 Mark AbrahamMerge branch release-5-1 into release-2016
2016-06-30 Mark AbrahamMerge branch release-5-1 into release-2016
2016-06-28 Teemu MurtolaSplit up compare.*
2016-06-27 Mark AbrahamMerge branch release-5-1 into release-2016
2016-06-22 Mark AbrahamMerge branch release-5-1 into release-2016
2016-06-17 Mark AbrahamMerge branch release-5-1 into release-2016
2016-06-08 Mark AbrahamMerge branch release-5-1 into release-2016
2016-05-12 Mark AbrahamMerge branch release-5-1 into release-2016
2016-05-05 Teemu MurtolaMerge branch release-5-1
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